CAS 138949-13-0|3-chloro-2-(1-methylhydrazin-1-yl)-5-(trifluoromethyl)pyridine|1-[3-Chloro-5-(trifluoromethyl)pyrid-2-yl]-1-methylhydrazine|3-chloro-2-(1-methylhydrazin-1-yl)-5-(trifluoromethyl)pyri...

General Information

Structure

Molecular Formula

C₇H₇ClF₃N₃

Molecular Mass

225.5987896

Exact Mass

225.02805958

Charge

InChI

InChI=1S/C7H7ClF3N3/c1-14(12)6-5(8)2-4(3-13-6)7(9,10)11/h2-3H,12H2,1H3

InChIKey

YGPUMJSRBNTPNO-UHFFFAOYSA-N

Canonic Smiles

CN(c1ncc(cc1Cl)C(F)(F)F)N

Isomeric Smiles

c1(cnc(c(c1)Cl)N(N)C)C(F)(F)F

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

2.049285

LogD (pH = 7.4)

2.2667994

Log P

2.2704828

Molar Refractivity

58.5051

Polarizability

17.117353

Polar Surface Area

42.15

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Commercial Catalog

Academic Data

Data Source

Names and Identifiers

IUPAC name

3-chloro-2-(1-methylhydrazin-1-yl)-5-(trifluoromethyl)pyridine

IUPAC Traditional name

3-chloro-2-(1-methylhydrazin-1-yl)-5-(trifluoromethyl)pyridine

Synonyms

1-[3-Chloro-5-(trifluoromethyl)pyrid-2-yl]-1-methylhydrazine1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-1-methylhydrazine1-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]-1-methylhydrazine3-Chloro-2-(1-methylhydrazino)-5-(trifluoromethyl)pyridine 97%3-Chloro-2-(1-Methylhydrazinyl)-5-(trifluoroMethyl)pyridine

Names and Identifiers

Registration numbers

CAS Number

MDL Number

PubChem SID

PubChem CID

Registration numbers

Properties